2-[(4-ethylphenyl)methyl]-3-(2-methylphenyl)propan-1-amine

C19H25N — CID 63496886

IUPAC2-[(4-ethylphenyl)methyl]-3-(2-methylphenyl)propan-1-amine
SMILESCCc1ccc(CC(CN)Cc2ccccc2C)cc1
InChIInChI=1S/C19H25N/c1-3-16-8-10-17(11-9-16)12-18(14-20)13-19-7-5-4-6-15(19)2/h4-11,18H,3,12-14,20H2,1-2H3
InChIKeyKFOXTUYWQJJMCK-UHFFFAOYSA-N
MW267.42 g/mol
LogP3.92
Rot. Bonds6

About 2-[(4-ethylphenyl)methyl]-3-(2-methylphenyl)propan-1-amine

2-[(4-ethylphenyl)methyl]-3-(2-methylphenyl)propan-1-amine (PubChem CID 63496886) has the molecular formula C19H25N and a molecular weight of 267.42 g/mol. Its IUPAC name is 2-[(4-ethylphenyl)methyl]-3-(2-methylphenyl)propan-1-amine.

Molecular Properties

Compound Name2-[(4-ethylphenyl)methyl]-3-(2-methylphenyl)propan-1-amine
PubChem CID63496886
Molecular FormulaC19H25N
Molecular Weight267.42 g/mol
Exact Mass267.20
IUPAC Name2-[(4-ethylphenyl)methyl]-3-(2-methylphenyl)propan-1-amine
SMILESCCc1ccc(CC(CN)Cc2ccccc2C)cc1
InChIInChI=1S/C19H25N/c1-3-16-8-10-17(11-9-16)12-18(14-20)13-19-7-5-4-6-15(19)2/h4-11,18H,3,12-14,20H2,1-2H3
InChIKeyKFOXTUYWQJJMCK-UHFFFAOYSA-N
XLogP3.92
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-[(4-ethylphenyl)methyl]-3-(2-methylphenyl)propan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(4-methylphenyl)-2-[(2-methylphenyl)methyl]propan-1-amine
CID 62504004
2-[(2-chlorophenyl)methyl]-3-(4-ethylphenyl)propan-1-amine
CID 63496346
2-[(3-fluorophenyl)methyl]-3-(2-methylphenyl)propan-1-amine
CID 62530380
2-(ethoxymethyl)-3-(2-methylphenyl)propan-1-amine
CID 103984194
2-[(4-chlorophenyl)methyl]-3-(4-ethylphenyl)propan-1-amine
CID 63498649
2-[(3-methoxyphenyl)methyl]-3-(2-methylphenyl)propan-1-amine
CID 62529007
1-[2-(bromomethyl)-3-(4-iodophenyl)propyl]-2-methylbenzene
CID 66041139
2-[(2,3-dichlorophenyl)methyl]-3-(2-methylphenyl)propan-1-amine
CID 107309626
2-[(2,5-dimethylphenyl)methyl]-3-(4-methylphenyl)propan-1-amine
CID 63496149
2-benzyl-3-(4-methylphenyl)propan-1-amine
CID 62504695
1-[2-(chloromethyl)-3-(4-fluorophenyl)propyl]-2-methylbenzene
CID 66034591
2-[(3-chloro-2-fluorophenyl)methyl]-3-(2-methylphenyl)propan-1-amine
CID 102858638

Frequently Asked Questions

What is the IUPAC name of 2-[(4-ethylphenyl)methyl]-3-(2-methylphenyl)propan-1-amine?
The IUPAC name of 2-[(4-ethylphenyl)methyl]-3-(2-methylphenyl)propan-1-amine (CID 63496886) is 2-[(4-ethylphenyl)methyl]-3-(2-methylphenyl)propan-1-amine.
What is the SMILES notation for 2-[(4-ethylphenyl)methyl]-3-(2-methylphenyl)propan-1-amine?
The canonical SMILES for 2-[(4-ethylphenyl)methyl]-3-(2-methylphenyl)propan-1-amine is CCc1ccc(CC(CN)Cc2ccccc2C)cc1.
What is the InChIKey of 2-[(4-ethylphenyl)methyl]-3-(2-methylphenyl)propan-1-amine?
The InChIKey is KFOXTUYWQJJMCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N/c1-3-16-8-10-17(11-9-16)12-18(14-20)13-19-7-5-4-6-15(19)2/h4-11,18H,3,12-14,20H2,1-2H3.
What are the key properties of 2-[(4-ethylphenyl)methyl]-3-(2-methylphenyl)propan-1-amine?
2-[(4-ethylphenyl)methyl]-3-(2-methylphenyl)propan-1-amine has a molecular weight of 267.42 g/mol, XLogP of 3.92, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-ethylphenyl)methyl]-3-(2-methylphenyl)propan-1-amine is sourced from PubChem (CID 63496886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).